7-[(6,7-dimethyl-2-oxidanylidene-chromen-4-yl)methyl]-1,3-dimethyl-purine-2,6-dione

Systemtic Name: 7-[(6,7-dimethyl-2-oxidanylidene-chromen-4-yl)methyl]-1,3-dimethyl-purine-2,6-dione Openeye Name: 7-[(6,7-dimethyl-2-oxo-chromen-4-yl)methyl]-1,3-dimethyl-purine-2,6-dione CAS Name: 7-[(6,7-dimethyl-2-oxo-1-benzopyran-4-yl)methyl]-1,3-dimethylpurine-2,6-dione IUPAC Name: 7-[(6,7-dimethyl-2-oxochromen-4-yl)methyl]-1,3-dimethylpurine-2,6-dione Traditional Name: 7-[(2-keto-6,7-dimethyl-chromen-4-yl)methyl]-1,3-dimethyl-xanthine Formula: C19H18N4O4 MolecularWeight: 366.37062

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C2C(=C1)C(=CC(=O)O2)CN3C=NC4=C3C(=O)N(C(=O)N4C)C)C

Isomeric SMILES

CC1=C(C=C2C(=C1)C(=CC(=O)O2)CN3C=NC4=C3C(=O)N(C(=O)N4C)C)C

InChI

InChI=1S/C19H18N4O4/c1-10-5-13-12(7-15(24)27-14(13)6-11(10)2)8-23-9-20-17-16(23)18(25)22(4)19(26)21(17)3/h5-7,9H,8H2,1-4H3